1-(3-methylbutyl)-3-[(2-oxidanylidenechromen-3-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[(2-oxidanylidenechromen-3-yl)carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[(2-oxochromene-3-carbonyl)amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(2-oxochromene-3-carbonyl)amino]thiourea Traditional Name: 1-isoamyl-3-[(2-ketochromene-3-carbonyl)amino]thiourea Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=CC2=CC=CC=C2OC1=O

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=CC2=CC=CC=C2OC1=O

InChI

InChI=1S/C16H19N3O3S/c1-10(2)7-8-17-16(23)19-18-14(20)12-9-11-5-3-4-6-13(11)22-15(12)21/h3-6,9-10H,7-8H2,1-2H3,(H,18,20)(H2,17,19,23)